3-[(2-chlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
3-[(2-chlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
Compound characteristics
| Compound ID: | 8640-0252 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one |
| Molecular Weight: | 375.88 |
| Molecular Formula: | C18 H18 Cl N3 O2 S |
| Smiles: | CCC1(C)Cc2c3C(N(Cc4ccccc4[Cl])N=Nc3sc2CO1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8598 |
| logD: | 4.8598 |
| logSw: | -5.0371 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.647 |
| InChI Key: | JKBXUFLAAIXOEQ-SFHVURJKSA-N |